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Currently displaying 16061 - 16080 of 30729 publications

Combination of Markov State Models and Kinetic Networks for the Analysis of Molecular Dynamics Simulations of Peptide Folding

IH Radford, AR Fersht, G Settanni

J Phys Chem B

(2011)

115

7459

(doi: 10.1021/jp112158w)

Spectrally Resolved Photoluminescence Imaging of ZnO Nanocrystals at Single-Particle Levels.

A Layek, S De, R Thorat, A Chowdhury

The Journal of Physical Chemistry Letters

(2011)

1241

(doi: 10.1021/jz200370s)

A breakthrough method for the accurate addition of reagents in multi-step segmented flow processing

H Lange, CF Carter, MD Hopkin, A Burke, JG Goode, IR Baxendale, SV Ley

Chemical Science

(2011)

765

(doi: 10.1039/c0sc00603c)

An upper limit for water dimer absorption in the 750 nm spectral region and a revised water line list

AJL Shillings, SM Ball, MJ Barber, J Tennyson, RL Jones

Atmospheric Chemistry and Physics

(2011)

4273

(doi: 10.5194/acp-11-4273-2011)

Experimental and database studies of three-centered halogen bonds with bifurcated acceptors present in molecular crystals, cocrystals and salts

D Cinčić, T Friščić, W Jones

Crystengcomm

(2011)

3224

(doi: 10.1039/c0ce00699h)

Microfluidic production of monodisperse functional o/w droplets and study of their reversible pH dependent aggregation behavior

W-AC Bauer, J Kotar, P Cicuta, RT Woodward, JVM Weaver, WTS Huck

Soft Matter

(2011)

4214

(doi: 10.1039/c1sm05087g)

Precise subnanometer plasmonic junctions for SERS within gold nanoparticle assemblies using cucurbit[n]uril "glue".

RW Taylor, T-C Lee, OA Scherman, R Esteban, J Aizpurua, FM Huang, JJ Baumberg, S Mahajan

ACS nano

(2011)

3878

(doi: 10.1021/nn200250v)

Development and Comparison of hERG Blocker Classifiers: Assessment on Different Datasets Yields Markedly Different Results

RL Marchese Robinson, RC Glen, JBO Mitchell

Mol Inform

(2011)

443

(doi: 10.1002/minf.201000159)

New FAAH inhibitors based on 3-carboxamido-5-aryl-isoxazole scaffold that protect against experimental colitis.

V Andrzejak, GG Muccioli, M Body-Malapel, J El Bakali, M Djouina, N Renault, P Chavatte, P Desreumaux, DM Lambert, R Millet

Bioorganic and Medicinal Chemistry

(2011)

3777

(doi: 10.1016/j.bmc.2011.04.057)

Supramolecular Glycopolymers in Water: A Reversible Route Toward Multivalent Carbohydrate–Lectin Conjugates Using Cucurbit[8]uril

J Geng, F Biedermann, JM Zayed, F Tian, OA Scherman

Macromolecules

(2011)

4276

(doi: 10.1021/ma200343q)

Asymmetric folding pathways and transient misfolding in a coarse-grained model of proteins

K Wolff, M Vendruscolo, M Porto

Epl

(2011)

48005

(doi: 10.1209/0295-5075/94/48005)

THE 2ND DIELECTRIC VIRIAL-COEFFICIENT OF DIPOLAR HARD-SPHERE FLUIDS

AD Buckingham, CG Joslin

Molecular Physics

(2011)

1513

(doi: 10.1080/00268978000102461)

Height-diameter allometry of tropical forest trees

TR Feldpausch, L Banin, OL Phillips, TR Baker, SL Lewis, CA Quesada, K Affum-Baffoe, EJMM Arets, NJ Berry, M Bird, ES Brondizio, P de Camargo, J Chave, G Djagbletey, TF Domingues, M Drescher, PM Fearnside, MB França, NM Fyllas, G Lopez-Gonzalez, A Hladik, N Higuchi, MO Hunter, Y Iida, KA Salim, AR Kassim, M Keller, J Kemp, DA King, JC Lovett, BS Marimon, BH Marimon-Junior, E Lenza, AR Marshall, DJ Metcalfe, ETA Mitchard, EF Moran, BW Nelson, R Nilus, EM Nogueira, M Palace, S Patiño, KS-H Peh, MT Raventos, JM Reitsma, G Saiz, F Schrodt, B Sonké, HE Taedoumg, S Tan, L White, H Wöll, J Lloyd

Biogeosciences

(2011)

1081

(doi: 10.5194/bg-8-1081-2011)

Absolute pKa Values and Solvation Structure of Amino Acids from Density Functional Based Molecular Dynamics Simulation.

M Mangold, L Rolland, F Costanzo, M Sprik, M Sulpizi, J Blumberger

Journal of Chemical Theory and Computation

(2011)

1951

(doi: 10.1021/ct100715x)

Realizing the biological and biomedical potential of nanoscale imaging using a pipette probe.

AI Shevchuk, P Novak, Y Takahashi, R Clarke, M Miragoli, B Babakinejad, J Gorelik, YE Korchev, D Klenerman

Nanomedicine (Lond)

(2011)

565

(doi: 10.2217/nnm.10.154)

Structure of Mixed Phosphatidylethanolamine and Cholesterol Monolayers in a Supported Hybrid Bilayer Membrane Studied by Sum Frequency Generation Vibrational Spectroscopy

PJN Kett, MTL Casford, PB Davies

The journal of physical chemistry. B

(2011)

115

6465

(doi: 10.1021/jp1112685)